| CAS Number | 1194688-12-4 |
| Catalog Number | AG0099PJ |
| Chemical Name | N-Benzyl-5-bromopyridin-3-amine |
| IUPAC Name | N-benzyl-5-bromopyridin-3-amine |
| InChI | InChI=1S/C12H11BrN2/c13-11-6-12(9-14-8-11)15-7-10-4-2-1-3-5-10/h1-6,8-9,15H,7H2 |
| InChI Key | MJROFMMRMPVTSU-UHFFFAOYSA-N |
| MDL Number | MFCD13190583 |
| Molecular Formula | C12H11BrN2 |
| Molecular Weight | 263.1331 |
| SMILES | BrC1=CC(NCC2=CC=CC=C2)=CN=C1 |
| Synonyms | N-BENZYL-5-BROMOPYRIDIN-3-AMINE,
1194688-12-4,
SCHEMBL2064845,
MJROFMMRMPVTSU-UHFFFAOYSA-N,
ZINC79048031,
AKOS032960546,
Benzyl-(5-bromo-pyridin-3-yl)-amine,
MB13420,
Z1172208650,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.138g/mol |
| Monoisotopic Mass | 262.011g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number